1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylphenyl)ethan-1-one
1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylphenyl)ethan-1-one
Compound characteristics
Compound ID: | 8010-2100 |
Compound Name: | 1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylphenyl)ethan-1-one |
Molecular Weight: | 401.3 |
Molecular Formula: | C20 H21 Br N2 O2 |
Smiles: | CCC1CC(c2ccc(cc2)[Br])(N(C(Cc2ccc(C)cc2)=O)N=1)O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.6393 |
logD: | 4.6393 |
logSw: | -4.3651 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.894 |
InChI Key: | NUUIQKDKEXBZNU-FQEVSTJZSA-N |